P   LATTICE,NONEQUIV.ATOMS   8   11 P21/m   
MODE OF CALC=RELA unit=bohr
 21.406818 15.503313  7.336673 90.000000 90.000000100.820000
ATOM  -1: X=0.80914000 Y=0.11087000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -1: X=0.19086000 Y=0.88913000 Z=0.75000000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.40073000 Y=0.21832000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -2: X=0.59927000 Y=0.78168000 Z=0.75000000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.88607000 Y=0.70360000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -3: X=0.11393000 Y=0.29640000 Z=0.75000000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.12468000 Y=0.59170000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -4: X=0.87532000 Y=0.40830000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.40611000 Y=0.85410000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -5: X=0.59389000 Y=0.14590000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.63356000 Y=0.52350000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -6: X=0.36644000 Y=0.47650000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  17.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.18320000 Y=0.10690000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -7: X=0.81680000 Y=0.89310000 Z=0.75000000
C          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   6.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.03990000 Y=0.02860000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -8: X=0.96010000 Y=0.97140000 Z=0.75000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   5.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000